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746274

Sigma-Aldrich

Vinblastine-13C2,d3

99 atom % 13C, 98 atom % D, 97% (CP)

Synonym(s):

13C,d Labeled Vinblastine

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About This Item

Empirical Formula (Hill Notation):
13C2C44D3H55N4O9
Molecular Weight:
815.98
UNSPSC Code:
12352005
PubChem Substance ID:
329765754

isotopic purity

99 atom % 13C
98 atom % D

Assay

97% (CP)

form

solid

technique(s)

mass spectrometry (MS): suitable

mass shift

M+5

storage temp.

2-8°C

SMILES string

O[C@@]1(CC)C[C@H]2C[N@](C1)CCC3=C([C@H](C(OC)=O)C2C4=C(OC)C=C(N(C)C5[C@@]67[C@]8([H])[C@](C=CCN8CC7)(CC)[C@@H](O[13C]([13C]([2H])([2H])[2H])=O)[C@@]5(C(OC)=O)O)C6=C4)NC9=CC=CC=C93

InChI

1S/C46H58N4O9/c1-8-43(54)23-27-24-49(25-43)19-15-29-28-13-10-11-14-32(28)47-37(29)36(38(52)57-6)35(27)30-21-31-33(22-34(30)56-5)48(4)40-45(31)17-20-50-18-12-16-44(9-2,39(45)50)41(59-26(3)51)46(40,55)42(53)58-7/h10-14,16,21-22,27,35-36,39-41,47,54-55H,8-9,15,17-20,23-25H2,1-7H3/t27?,35?,36-,39+,40?,41-,43?,44-,45-,46+/m1/s1/i3+1D3,26+1

InChI key

KPPBSXVQPGVPRR-JDAPZIMESA-N

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