ID: 89020
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC(=O)C)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 89021
SMILES:c1(O)cc(Cc2c(O)cc(C(C)=O)cc2)c2c(c1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -13.844
InChIKey:YADZADVSNKPYLI-UHFFFAOYSA-N
ID: 89022
SMILES:C12(c3c(cc(CCCCC)cc3OC)OC1(C)C)C(O)=C(C)C(=O)C2(C(O)C(C)=C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -12.919
InChIKey:QAIRXAFNEDDMBG-UHFFFAOYSA-N
ID: 89023
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(CCC1C(C)(C)O1)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.88
InChIKey:YOKGZPDJGXKSEW-UHFFFAOYSA-N
ID: 89024
SMILES:C(CCCC=C)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.364
InChIKey:GGQPOSCJAWXHFW-UHFFFAOYSA-N
ID: 89025
SMILES:c12ccc(O)cc1OC(C)(C)C1CCC(COC(=O)C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -16.893
InChIKey:DMRBRXIHDNTTDN-UHFFFAOYSA-N
ID: 89026
SMILES:C(C)CCCCc1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.06
InChIKey:DUNLYOQOJQUZRD-UHFFFAOYSA-N
ID: 89027
SMILES:C(CCC(CC)=O)(C)=CCCC1(C)C=Cc2cc(O)cc(C)c2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.814
InChIKey:YWTJMLQUBCDJQM-UHFFFAOYSA-N
ID: 89028
SMILES:C12c3c(cc(CCC)cc3O)OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.109
InChIKey:VHLVOKUKQDCEHX-UHFFFAOYSA-N
ID: 89029
SMILES:c1(CCl)c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.957
CB1 binding score: -15.179
InChIKey:COLZEKOEOIZCPZ-UHFFFAOYSA-N
ID: 89030
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 89031
SMILES:C(CCCC)c1cc2c(c(O)c1)C1(C)C(O2)CCC(C)=CCC(C)(C)C=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.129
InChIKey:ANBIMNFIEFDRRB-UHFFFAOYSA-N
ID: 89032
SMILES:C1(O)C(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.22
InChIKey:IEIRTDYRAWGSAW-UHFFFAOYSA-N
ID: 89033
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89034
SMILES:C1(O)C2=CCC3C(C)(CCCC3(C)C(=O)O)C2c2c(O)cc(CCCCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.429
InChIKey:UKYAZDXCJQFKJH-UHFFFAOYSA-N
ID: 89035
SMILES:c1(O)cc2c(cc1CCC)OC(C)(C)C1C2CC(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.69
InChIKey:IWJUYZWXOLOMJH-UHFFFAOYSA-N
ID: 89036
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C=CC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.49
InChIKey:VVPRQBFCNVKQGV-UHFFFAOYSA-N
ID: 89037
SMILES:OC12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(C)C(O)CC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.042
InChIKey:IFPXVRLILRQXPX-UHFFFAOYSA-N
ID: 89038
SMILES:C(CCc1cc2c(c(O)c1)C1C(O)C(CO)=CCC1C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.631
InChIKey:LQLPYYCVDFRVFF-UHFFFAOYSA-N
ID: 89039
SMILES:C(CCc1ccco1)=Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -14.819
InChIKey:SNPIOPPFZBRYPO-UHFFFAOYSA-N
ID: 89040
SMILES:C1=CC(C)(O)CCC2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.26
InChIKey:HORSMAAJWXEDES-UHFFFAOYSA-N