A-649

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C58H84O26
Molecular Weight	1197.272
Optical Activity	UNSPECIFIED
Defined Stereocenters	25 / 25
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(C[C@@H](O[C@@]2([H])C[C@](C)(O)[C@@H](OC(=O)C(C)C)[C@H](C)O2)[C@H](O)[C@@H](C)O1)O[C@@H]3C[C@]([H])(O[C@@H]4C(=O)C5=C(O)C6=C(C=C(O[C@H]7C[C@@H](OC(C)=O)[C@@H](O[C@]8([H])C[C@@H](O)[C@@H](OC)[C@@H](C)O8)[C@@H](C)O7)C=C6O)C=C5C[C@@]4([H])[C@H](OC)C(=O)[C@@H](O)[C@@H](C)O)O[C@H](C)[C@H]3O

InChI

InChIKey=WURKLEUBADSHTC-AJVJTBPOSA-N

InChI=1S/C58H84O26/c1-22(2)57(69)84-56-28(8)77-43(21-58(56,10)70)81-37-18-41(73-24(4)48(37)65)80-36-19-42(74-25(5)47(36)64)83-55-33(54(72-12)51(68)46(63)23(3)59)15-31-13-30-14-32(16-34(61)44(30)49(66)45(31)50(55)67)79-40-20-38(78-29(9)60)53(27(7)76-40)82-39-17-35(62)52(71-11)26(6)75-39/h13-14,16,22-28,33,35-43,46-48,52-56,59,61-66,70H,15,17-21H2,1-12H3/t23-,24-,25-,26-,27-,28+,33+,35-,36-,37-,38-,39-,40+,41+,42+,43+,46+,47-,48-,52+,53+,54+,55+,56+,58+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C58H84O26
Molecular Weight	1197.272
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	25 / 25
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:41:04 GMT 2023` Edited by `admin` on `Sat Dec 16 05:41:04 GMT 2023`
Record UNII	I00H3G1Y5M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

A-649

Common Name

English

ANTIBIOTIC A-649

Common Name

English

NSC-38270

Code

English

Code System Code Type Description

NSC

38270

Created by admin on Sat Dec 16 05:41:04 GMT 2023 , Edited by admin on Sat Dec 16 05:41:04 GMT 2023

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CAS

102647-16-5

Created by admin on Sat Dec 16 05:41:04 GMT 2023 , Edited by admin on Sat Dec 16 05:41:04 GMT 2023

PRIMARY

PUBCHEM

462379

Created by admin on Sat Dec 16 05:41:04 GMT 2023 , Edited by admin on Sat Dec 16 05:41:04 GMT 2023

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FDA UNII

I00H3G1Y5M

Created by admin on Sat Dec 16 05:41:04 GMT 2023 , Edited by admin on Sat Dec 16 05:41:04 GMT 2023

PRIMARY