COMPOUND: C10770
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Entry
C10770 Compound
Name
Bilobol;
5-[(8Z)-Pentadec-8-en-1-yl]benzene-1,3-diol
Formula
C21H34O2
Exact mass
318.2559
Mol weight
318.4935
Structure
Mol file
KCF file
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Brite
Lipids [BR:
br08002
]
PK Polyketides
PK15 Phenolic lipids
PK1503 Alkyl resorcinols and derivatives
C10770 Bilobol
BRITE hierarchy
Other DBs
CAS:
22910-86-7
PubChem:
12953
ChEBI:
3104
LIPIDMAPS:
LMPK15030001
KNApSAcK:
C00002640
NIKKAJI:
J167.340H
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KCF data
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ATOM 23
1 C8x C 22.5508 -19.5519
2 C8y C 22.5508 -20.9548
3 C8x C 23.7697 -21.6599
4 C8y C 24.9745 -20.9548
5 C8x C 24.9745 -19.5519
6 C8y C 23.7697 -18.8538
7 C1b C 26.1913 -21.6591
8 C1b C 27.4017 -20.9479
9 C1b C 28.6144 -21.6528
10 C1b C 29.8272 -20.9479
11 C1b C 31.0398 -21.6528
12 C1b C 32.2526 -20.9479
13 C1b C 33.4584 -21.6528
14 C2b C 34.6711 -20.9479
15 C2b C 34.6640 -19.5447
16 C1b C 33.4444 -18.8528
17 C1b C 32.2386 -19.5447
18 C1b C 31.0258 -18.8467
19 C1b C 29.8130 -19.5447
20 C1b C 28.6004 -18.8467
21 C1a C 27.3876 -19.5447
22 O1a O 23.7715 -17.4507
23 O1a O 21.3581 -21.6426
BOND 23
1 10 11 1
2 5 6 2
3 11 12 1
4 6 1 1
5 12 13 1
6 13 14 1
7 4 7 1
8 14 15 2
9 1 2 2
10 15 16 1
11 7 8 1
12 16 17 1
13 2 3 1
14 17 18 1
15 8 9 1
16 18 19 1
17 3 4 2
18 19 20 1
19 9 10 1
20 20 21 1
21 4 5 1
22 6 22 1
23 2 23 1
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