Macbecin I

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H42N2O8
Molecular Weight	558.6631
Optical Activity	( + )
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1C[C@H](C)[C@@H](OC)C2=CC(=O)C=C(NC(=O)\C(C)=C\C=C[C@H](C)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1OC)C2=O

InChI

InChIKey=PLTGBUPHJAKFMA-BMJWZTMLSA-N

InChI=1S/C30H42N2O8/c1-16-10-9-11-17(2)29(35)32-23-15-21(33)14-22(25(23)34)27(38-7)20(5)13-24(37-6)28(39-8)19(4)12-18(3)26(16)40-30(31)36/h9-12,14-16,19-20,24,26-28H,13H2,1-8H3,(H2,31,36)(H,32,35)/b10-9-,17-11+,18-12+/t16-,19-,20-,24-,26+,27+,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H42N2O8
Molecular Weight	558.6631
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:55:32 GMT 2025` Edited by `admin` on `Tue Apr 01 19:55:32 GMT 2025`
Record UNII	GB3Z258LF8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Macbecin I

Common Name

English

NSC-330499

Preferred Name

English

(15R)-6,17-Didemethoxy-15-methoxy-6-methyl-11-O-methylgeldanamycin

Systematic Name

English

Geldanamycin, 6,17-didemethoxy-15-methoxy-6-methyl-11-O-methyl-, (15R)-

Systematic Name

English

(+)-Macbecin I

Common Name

English

Macbecin

Common Name

English

Code System Code Type Description

PUBCHEM

10886216