Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: PA 46101 A
RN: 130743-11-2
InChIKey: GUUBJNZJQYYEGQ-UHFFFAOYSA-N

Note

  • From Streptomyces strain PA-46101.

Molecular Formula

  • C52-H70-O18

Molecular Weight

  • 983.107
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • PA 46101 A

Synonym

  • PA-46101 A

Systematic Name

  • 16H-14a,17-Metheno-14aH-benzo(e)naphtho(2,1-k)(1,4)dioxacyclotridecin-12-carboxylic acid, 4-((6-deoxy-3-O-(2,6-dideoxy-4-O-methyl-beta-D-ribo-hexopyranosyl)-4-O-(2-methoxy-6-methylbenzoyl)-beta-D-allopyranosyl)oxy)-13-ethyl-1,2,3,4,4a,6a,7,8,9,10,10a,13,14,19,19a,19b-hexadecahydro-3,20-dihydroxy-6,10a,19a-trimethyl-16,19-dioxo-, (3S-(3R*,4S*,4aR*,6aR*,10aS*,13S*,14aR*,19aR*,19bS*))-

Registry Numbers

CAS Registry Number

  • 130743-11-2

System Generated Number

  • 0130743112

Structure Descriptors

InChI

1S/C52H70O18/c1-10-28-22-52-44(56)43(47(60)70-52)69-49(61)51(7)31(15-11-12-19-50(52,6)23-30(28)45(57)58)25(3)20-29-32(51)17-18-33(53)41(29)68-48-38(55)42(66-36-21-34(54)39(63-9)26(4)64-36)40(27(5)65-48)67-46(59)37-24(2)14-13-16-35(37)62-8/h13-14,16,20,23,26-29,31-34,36,38-42,48,53-56H,10-12,15,17-19,21-22H2,1-9H3,(H,57,58)

InChIKey

GUUBJNZJQYYEGQ-UHFFFAOYSA-N

Smiles

CCC1CC23C(=C(C(=O)O2)OC(=O)C4(C5CCC(C(C5C=C(C4CCCCC3(C=C1C(=O)O)C)C)OC6C(C(C(C(O6)C)OC(=O)c7c(cccc7OC)C)OC8CC(C(C(O8)C)OC)O)O)O)C)O