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None

AlkaPlorer ID: AK436480

Synonym: None

IUPAC Name: [(2R,3S,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-2-[[(10R)-10-hydroxy-8-[(2S)-2-methylbutanoyl]-3-oxo-1,4,8-triazacyclotridec-1-yl]oxy]-6-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (2S)-2-methylbutanoate

Structure

SMILES: CC[C@H](C)C(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](ON3CCC[C@@H](O)CN(C(=O)[C@@H](C)CC)CCCN=C(O)C3)O[C@@H](C)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

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InChI: InChI=1S/C32H57N3O14/c1-6-17(3)29(43)34-12-9-11-33-22(37)15-35(13-8-10-20(36)14-34)49-32-28(26(41)23(38)19(5)46-32)48-31-27(42)25(40)24(39)21(47-31)16-45-30(44)18(4)7-2/h17-21,23-28,31-32,36,38-42H,6-16H2,1-5H3,(H,33,37)/t17-,18-,19-,20+,21+,23-,24+,25-,26+,27+,28+,31-,32-/m0/s1

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InChIKey: KQINXJBCACYQDM-ZIHKGLJOSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Meehania urticifolia Meehania Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 707.8150000000007

TPSA？: 240.73999999999995

MolLogP？: -1.1552999999999929

Number of H-Donors: 7

Number of H-Acceptors: 15

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information