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CAS 57-22-7 Vincristine molecular structure lightbox
CAS RN: 57-22-7

Vincristine

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6 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260114 100mg In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20250707 20mg In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20260323 250mg In stock Shandong Inquiry
Batchno.20260203 5mg In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250918 100mg Out of stock Inquiry
Batchno.20260428 10mg Out of stock Inquiry
  • Product code: starshine_CAS57-22-7
  • Purity/Analytical Methods: >99.0%
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57-22-7 / methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(13S,15S,17S)-17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl]-8-formyl-10-hydroxy-5-methoxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate

Standard CAS: 57-22-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
57-22-7
Multi CAS
Yes
Molecular Formula
C46H56N4O10
Molecular Weight
825.000000
Exact Mass
824.399644
InChI
InChI=1S/C46H56N4O10/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3/t28-,37+,38-,39-,42+,43-,44-,45+,46+/m1/s1
InChIKey
OGWKCGZFUXNPDA-XQKSVPLYSA-N

Physical Properties

Melting Point
424 to 428 °F (NTP, 1992) 218-220 °C 220 °C
Physical Description
Vincristine appears as a white crystalline solid. Melting point 218 °C. Used as an antineoplastic. Solid
Appearance
Blades from methanol
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
60
Aromatic heavy atom count
15
Fraction Csp3
0.57
Rotatable bonds
8
H-bond acceptors
12
H-bond donors
3
Molar refractivity
220.57
TPSA
171.17

LogP / Solubility

WLOGP
3.52
MLOGP
3.17
XLogP3
2.8
Consensus LogP
3.16
Log S (ESOL)
-6.83
Class (ESOL)
Insoluble
Log S (Ali)
-8.86
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.9
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-5.25

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

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