ID: 52018
SMILES:CC1(C)C2CCC(C)(OC(=O)C)CC2c2c(cc(C)c(OC(=O)C(C)=C)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.607
InChIKey:JIBCOHVPCXMFKF-UHFFFAOYSA-N
ID: 52019
SMILES:CCCCc1c2c(c(C(C(CC)C)=O)c(O)c1)OC1(C)C(C2C=C(C)C)CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -11.876
InChIKey:VALVNKJJGPLYDW-UHFFFAOYSA-N
ID: 52020
SMILES:C12(C)CCC(C(C)=C)C(c3c(O)cc(CCC)cc3O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.107
InChIKey:IUMNPRHFHDBZHF-UHFFFAOYSA-N
ID: 52021
SMILES:c1(O)c(C(C)(C)C)cc(O)c2c1OC(C)(C)C1CCC(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.703
InChIKey:UEMINFGFQKFLOG-UHFFFAOYSA-N
ID: 52022
SMILES:O1c2c(cc(C)c(CCC(C(C)(O)C)O)c2)CC(O)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -14.469
InChIKey:DQAVLNXHIWNVIK-UHFFFAOYSA-N
ID: 52023
SMILES:OCC1(C)CCC(O)C2(CO)c3c(O)cc(CCCCC)cc3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -16.713
InChIKey:OMLHBYMVNGARCK-UHFFFAOYSA-N
ID: 52024
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 52025
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 52026
SMILES:O1C(CC(=CCc2c(O)c(C)cc(OC)c2)COC(C)=O)C(=O)CC1(C)CC(OCC)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.555
CB1 binding score: -16.314
InChIKey:HWOSRGHPQBCQGF-UHFFFAOYSA-N
ID: 52027
SMILES:O(c1cc(C)cc2c1C1C3C(C(CCCC(C)C)(C)O3)CCC1(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.218
InChIKey:AETVURHEARIAIM-UHFFFAOYSA-N
ID: 52028
SMILES:C=C1CC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.892
InChIKey:DSPAMLIHSJRXPO-UHFFFAOYSA-N
ID: 52029
SMILES:C12C(C)(CC(O)CC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.906
InChIKey:DLZOIILMDQLHIN-UHFFFAOYSA-N
ID: 52030
SMILES:Oc1c(C(O)=O)c(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 52031
SMILES:C(C)(C)=CCCC1(C)C2CCC(C)=CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.283
InChIKey:GLLKPEGVVBFGKX-UHFFFAOYSA-N
ID: 52032
SMILES:CC(=CCc1c(CCCC)cc(O)c(CC=C(C)C)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.06
InChIKey:PROSCOMHGNQLIT-UHFFFAOYSA-N
ID: 52033
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C3(C)CC(OCC)OCC13CCC2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.921
InChIKey:KTIZEGPAIDWPQI-UHFFFAOYSA-N
ID: 52034
SMILES:CC1CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.479
InChIKey:LBIQTJYHOQJYJR-UHFFFAOYSA-N
ID: 52035
SMILES:CC(=O)OC1C(COC(C)=O)=CC2C(=O)C3(C=C(C)C1OC3=O)C1(CC(C)(C)OC1c1ccccc1)OC(CCCCCCC)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 650.809
CB1 binding score: -12.899
InChIKey:JTARIIQLXDDXCJ-UHFFFAOYSA-N
ID: 52036
SMILES:C1(C)(C)Oc2cc(Br)c3c(c21)OC(C)(C)C1C3CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 365.311
CB1 binding score: -16.664
InChIKey:UGKJIFRWJWUBDH-UHFFFAOYSA-N
ID: 52037
SMILES:c12c3c(cc(C)cc3oc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -15.715
InChIKey:WCOONOFOOUEICE-UHFFFAOYSA-N
ID: 52038
SMILES:COc1cc(CCCCC)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.978
InChIKey:KBHYWFRGGLCWNO-UHFFFAOYSA-N