VINLEUCINOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C51H69N5O9
Molecular Weight	896.1217
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N3CC[C@@]14C5=C(C=C(OC)C(=C5)[C@]6(C[C@@]7([H])CN(C[C@](O)(CC)C7)CCC8=C6NC9=C8C=CC=C9)C(=O)OC)N(C)[C@@]4([H])[C@](O)([C@H](O)[C@]2(CC)C=CC3)C(=O)N[C@@H]([C@@H](C)CC)C(=O)OCC

InChI

InChIKey=QSTPFUDHVVIGCL-MIESHYDTSA-N

InChI=1S/C51H69N5O9/c1-9-30(5)39(41(57)65-12-4)53-45(59)51(62)43-49(20-23-56-21-15-19-48(11-3,42(49)56)44(51)58)34-24-35(38(63-7)25-37(34)54(43)6)50(46(60)64-8)27-31-26-47(61,10-2)29-55(28-31)22-18-33-32-16-13-14-17-36(32)52-40(33)50/h13-17,19,24-25,30-31,39,42-44,52,58,61-62H,9-12,18,20-23,26-29H2,1-8H3,(H,53,59)/t30-,31-,39-,42-,43+,44+,47-,48+,49+,50-,51-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C51H69N5O9
Molecular Weight	896.1217
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:53:37 UTC 2023` Edited by `admin` on `Fri Dec 15 15:53:37 UTC 2023`
Record UNII	MUJ5BW9BWR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VINLEUCINOL

Official Name

English

(23(1S,2S))-4-DEACETYL-3-((1-CARBOXY-2-METHYLBUTYL)CARBAMOYL)-3-DE(METHOXYCARBONYL)VINCALEUKOBLASTINE, ETHYL ESTER

Common Name

English

VINBLASTINE ISOLEUCINATE

Common Name

English

N-(O4-DEACETYL-23-VINBLASTINOYL) ETHYL L-ISOLEUCINATE

Common Name

English

vinleucinol [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C932