RUTAMYCIN B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C44H72O10
Molecular Weight	761.0365
Optical Activity	UNSPECIFIED
Defined Stereocenters	17 / 17
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(C[C@H](C)O)O[C@]2(CC[C@H]1C)C[C@@]3([H])OC(=O)\C=C\[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@H](C)[C@H](O)[C@@H](C)C\C=C\C=C\[C@@]([H])(CC)CC[C@@]([H])(O2)[C@@H]3C

InChI

InChIKey=NLTVXGAGXODEBS-ULZPCFQASA-N

InChI=1S/C44H72O10/c1-11-34-16-14-12-13-15-26(3)39(47)30(7)41(49)32(9)43(51)33(10)42(50)31(8)40(48)27(4)17-20-38(46)52-37-24-44(53-35(19-18-34)29(37)6)22-21-25(2)36(54-44)23-28(5)45/h12-14,16-17,20,25-37,39-40,43,45,47-48,51H,11,15,18-19,21-24H2,1-10H3/b13-12+,16-14+,20-17+/t25-,26+,27-,28+,29+,30-,31-,32+,33-,34-,35-,36-,37-,39-,40+,43-,44-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C44H72O10
Molecular Weight	761.0365
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	17 / 17
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:44:58 GMT 2023` Edited by `admin` on `Fri Dec 15 18:44:58 GMT 2023`
Record UNII	68238TYU5H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RUTAMYCIN B

Common Name

English

Code System Code Type Description

FDA UNII

68238TYU5H

Created by admin on Fri Dec 15 18:44:58 GMT 2023 , Edited by admin on Fri Dec 15 18:44:58 GMT 2023

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PUBCHEM

9896973

Created by admin on Fri Dec 15 18:44:58 GMT 2023 , Edited by admin on Fri Dec 15 18:44:58 GMT 2023

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