ID: 44185
SMILES:O1C2=CC3(c4c(cc(CCCCC)cc4O)OC13)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.317
CB1 binding score: -14.742
InChIKey:AVNUORNOODRNIT-UHFFFAOYSA-N
ID: 44186
SMILES:O1CC(O)(CO)C2Oc3c(c(O)cc(CCCCC)c3)C3C2C13
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -15.924
InChIKey:UTVWENLXPFJNFE-UHFFFAOYSA-N
ID: 44187
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.195
InChIKey:HCAHPGZYSHQZKS-UHFFFAOYSA-N
ID: 44188
SMILES:C(CCC)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -19.478
InChIKey:UELYWRAKVJEDIL-UHFFFAOYSA-N
ID: 44189
SMILES:C(CC(C)=CCc1c(OC)c(C)cc(O)c1)C(C(=C)C)CCC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.262
InChIKey:PBNXXRUZPZIASS-UHFFFAOYSA-N
ID: 44190
SMILES:C(O)C1(C)C2CCC(C)C23C(c2c1cc(CCCCC)cc2O)OC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.918
InChIKey:VHZAPIQWYJBEPV-UHFFFAOYSA-N
ID: 44191
SMILES:CC1(C)C2CC=C(C)CC2c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.334
InChIKey:YNNFYMQFHNFBDP-UHFFFAOYSA-N
ID: 44192
SMILES:OC1=C(C(CC(=O)OC)c2c(O)c(C3C=C(C)CCC3C(=C)C)c(O)cc2)CCC(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -12.67
InChIKey:NOVLDVBKLBBWII-UHFFFAOYSA-N
ID: 44193
SMILES:Cc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.006
InChIKey:SUFPQJMELBBUPW-UHFFFAOYSA-N
ID: 44194
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -12.143
InChIKey:KPIFFUZCQQXZIQ-UHFFFAOYSA-N
ID: 44195
SMILES:Oc1c(C(O)=O)c(CCCCC)cc2c1OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.588
InChIKey:PDIWLIREMMESEV-UHFFFAOYSA-N
ID: 44196
SMILES:C1CCC2(c3c(cc(CCCCC)cc3O)OC2OC)C2(C)C1C(C)(C)CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -12.392
InChIKey:ZUPXEVGWKFRNRP-UHFFFAOYSA-N
ID: 44197
SMILES:C(=O)(C12c3c(O)cc(CCCCC)cc3Oc3cc(C)c(O)cc3C1(CO)CCCC2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -14.321
InChIKey:FDUYMDALTPPHFM-UHFFFAOYSA-N
ID: 44198
SMILES:c12cc(CCCCCC)cc(O)c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.357
InChIKey:QLJKRNAQULDIOJ-UHFFFAOYSA-N
ID: 44199
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(=O)O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 44200
SMILES:C1C2C(c3c(O)cc(CCC)cc3OC2(CCC=C(C)C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.11
InChIKey:YGCGUHHJEYUEEA-UHFFFAOYSA-N
ID: 44201
SMILES:C1(C(=C)C)C(c2c(O)cc(C)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 44202
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44203
SMILES:CN1c2c3c(cc(O)c2-c2c(O)c(C)cc(O)c21)C(C)(C)C(CC=C(C)C)(CC=C(C)C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.619
CB1 binding score: -15.929
InChIKey:YVAGSQVMFJGYOV-UHFFFAOYSA-N
ID: 44204
SMILES:C1=C(C(=O)OC)C2CC(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.247
InChIKey:JLVKWBQNJWVVJH-UHFFFAOYSA-N
ID: 44205
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC(C)=CC(O)C(O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: Not available
InChIKey:QSMOBJGVOYDGOQ-UHFFFAOYSA-N