ID: 55399
SMILES:C(CCC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.042
InChIKey:FNFYNDHHRPRLKW-UHFFFAOYSA-N
ID: 55400
SMILES:CC1=CCCC12C(C)(C)Oc1c(cccc1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -15.198
InChIKey:GKCRISIHCNVLFS-UHFFFAOYSA-N
ID: 55401
SMILES:C(=CCCC1(C)C=Cc2c(O)cc(CCC)cc2O1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 55402
SMILES:C1=C(C)C(OC(=O)C)CC2C(C)(C)Oc3c(c(OC)cc(O)c3C(=O)OC(C)C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -14.213
InChIKey:FIIZQIXMXFGXFW-UHFFFAOYSA-N
ID: 55403
SMILES:O1c2c(c(O)cc(CC)c2)C2C=C(C)CCC2C1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.826
InChIKey:NKBQRXXMLZRAQW-UHFFFAOYSA-N
ID: 55404
SMILES:C1(=O)C2(C)CC(C(OC)=O)C(C(C)C)C1c1c(O)cc(OC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.395
CB1 binding score: -16.011
InChIKey:NMPCUZQUIIPSBV-UHFFFAOYSA-N
ID: 55405
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(C(C)C)c(O)c(c32)C(=O)O)C2C1C(O)(C(=O)O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -14.605
InChIKey:OVDZKFXJRVHADW-UHFFFAOYSA-N
ID: 55406
SMILES:C1C2C(=C)C(OC(C)=O)C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.791
InChIKey:BNZGYEIJBFONSX-UHFFFAOYSA-N
ID: 55407
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.224
InChIKey:FTRRSPPOMZCCCX-UHFFFAOYSA-N
ID: 55408
SMILES:c1(CC=C(C)C)c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 326.48
CB1 binding score: -17.173
InChIKey:BHLIQLIUQSBQKB-UHFFFAOYSA-N
ID: 55409
SMILES:CCCCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 55410
SMILES:C(=C1CC(=O)C(C)(Oc2c(CC=C(C)C)c(O)cc(C)c2)CC1)C=CC(C)(C)OO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.652
InChIKey:GKPRDPMVXZJKPO-UHFFFAOYSA-N
ID: 55411
SMILES:c1(OC)cc(CCCCC)c(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.091
InChIKey:LEOGMTYTYSRFAF-UHFFFAOYSA-N
ID: 55412
SMILES:O=C(C)OCCCC(C)(C)C(O)c1cc2c(c(O)c1)CC1C(CCC1(O)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -13.336
InChIKey:QRRJLOLMTKIZJT-UHFFFAOYSA-N
ID: 55413
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.168
InChIKey:OGQUFUKUTFQVAV-UHFFFAOYSA-N
ID: 55414
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.771
InChIKey:VGSHJKOXKGYENI-UHFFFAOYSA-N
ID: 55415
SMILES:C1C(O)c2cc(C(O)=O)c(CCCCC)cc2OC1C(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -15.179
InChIKey:HSULLGBDVXUULV-UHFFFAOYSA-N
ID: 55416
SMILES:c1(C(C)C(O)CO)cc2c(c3c1OC(C)(C)C=C3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.334
InChIKey:JQIBBJYWUCWLNN-UHFFFAOYSA-N
ID: 55417
SMILES:C(c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)Cc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.146
InChIKey:WRZFOUWZUHOJFS-UHFFFAOYSA-N
ID: 55418
SMILES:c1(CCCC)cc(O)c2c(c1C(O)=O)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.292
InChIKey:MACLCFRMOXXOTO-UHFFFAOYSA-N
ID: 55419
SMILES:C(CCC)CCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.188
InChIKey:GGHRHCGOMWNLCE-UHFFFAOYSA-N