ID: 44017
SMILES:C1(CCC=C(C(=O)OC)C)(C)c2cc(O)c(C)cc2OC(C)(C)C=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.573
InChIKey:MEYAOYGOMBIQCO-UHFFFAOYSA-N
ID: 44018
SMILES:C(C)CCCCc1c(O)c2c(c(C=O)c1O)OC1(C3(C)C4(C)C(CCC3C)C21)CC(C)(C)O4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.94
InChIKey:PGYDBQLWJKLYHA-UHFFFAOYSA-N
ID: 44019
SMILES:C1(c2c(O)cc(C)cc2)C(C(=C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 44020
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC(=O)O1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.148
InChIKey:DZPOMMWTQRQFLZ-UHFFFAOYSA-N
ID: 44021
SMILES:CC1(C)Oc2c(cc(C)c(C)c2)C2CCC(C)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -12.671
InChIKey:FCHARNRFQLOUGH-UHFFFAOYSA-N
ID: 44022
SMILES:C1(O)CC2C(C)(C)C1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.93
InChIKey:WDAKIPVGDUUVAT-UHFFFAOYSA-N
ID: 44023
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -16.815
InChIKey:LAHMAXNXYRHYDC-UHFFFAOYSA-N
ID: 44024
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 44025
SMILES:CC(=CCCC(C)C1c2c(C(=O)O)cc(CCCC)cc2OC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.212
InChIKey:FJWZYLSTLCIKSR-UHFFFAOYSA-N
ID: 44026
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(COC(=O)CC(O)(C)CC(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -15.576
InChIKey:RTHQKCVEGAHIEB-UHFFFAOYSA-N
ID: 44027
SMILES:OCC(C1=C(CCCC)C(=O)C23C(=O)OC(C)(C4C2C3(C)CCC4O)C1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.682
InChIKey:WOPPRMSPVHARPP-UHFFFAOYSA-N
ID: 44028
SMILES:c12c(O)cc(C(C)C(=CC)C)cc1C=CC(C)(CCC=C(CCC=C(C)C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -14.739
InChIKey:SQKIZPMIVOFOHE-UHFFFAOYSA-N
ID: 44029
SMILES:Oc1cc(CCC)ccc1C1(C)CCCC(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -16.579
InChIKey:MHPXFCOSNXMAON-UHFFFAOYSA-N
ID: 44030
SMILES:c12c(cc(Cl)c(O)c1CCCCC)OC(C=C)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.822
CB1 binding score: -16.821
InChIKey:DUKMEYFLVQWGEP-UHFFFAOYSA-N
ID: 44031
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 44032
SMILES:c1(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 44033
SMILES:C1(C)CCC=C(C)C(=O)C=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: Not available
InChIKey:ZTOWOLWMWYWCFB-UHFFFAOYSA-N
ID: 44034
SMILES:C(CCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CC(C)(O)CC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.001
InChIKey:VRDKXXLHCOJZNJ-UHFFFAOYSA-N
ID: 44035
SMILES:c12c(cc(OC)cc1)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.717
InChIKey:FTVMCFYNPGBNKQ-UHFFFAOYSA-N
ID: 44036
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(C=C)c(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.251
InChIKey:CTLJSUZHVISIKG-UHFFFAOYSA-N
ID: 44037
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N