MARCELLOMYCIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H55NO17
Molecular Weight	845.8826
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O[C@H]3C[C@H](O)[C@H](O[C@H]4C[C@H](O)[C@H](O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)N(C)C)C5=C(C=C6C(=O)C7=C(C(O)=CC=C7O)C(=O)C6=C5O)[C@H]1C(=O)OC

InChI

InChIKey=VJRAUFKOOPNFIQ-TVEKBUMESA-N

InChI=1S/C42H55NO17/c1-8-42(53)15-26(30-19(34(42)41(52)54-7)11-20-31(37(30)50)38(51)33-23(45)10-9-22(44)32(33)36(20)49)58-27-12-21(43(5)6)39(17(3)56-27)59-29-14-25(47)40(18(4)57-29)60-28-13-24(46)35(48)16(2)55-28/h9-11,16-18,21,24-29,34-35,39-40,44-48,50,53H,8,12-15H2,1-7H3/t16-,17-,18-,21-,24-,25-,26-,27-,28-,29-,34-,35+,39+,40+,42+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H55NO17
Molecular Weight	845.8826
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:55:50 GMT 2025` Edited by `admin` on `Mon Mar 31 20:55:50 GMT 2025`
Record UNII	3296X8L13E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANTIBIOTIC MA-144U2

Preferred Name

English

MARCELLOMYCIN

Common Name

English

NSC-265211

Code

English

RHODIRUBIN E

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1594