ID: 52858
SMILES:C1CC(=C)C2C(OC)C1C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.136
InChIKey:GGIXTAXPFNQCSS-UHFFFAOYSA-N
ID: 52859
SMILES:O=C1CC2c3c(cc(CCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.754
InChIKey:GCRCCBXLJFNYLP-UHFFFAOYSA-N
ID: 52860
SMILES:Oc1cc2c(cc1CCCCC)OC1(C(C)(C)Oc3ccccc13)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -16.248
InChIKey:MIMZZZHZQZWYDG-UHFFFAOYSA-N
ID: 52861
SMILES:C1(O)C(C)(C)Oc2ccc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids;Merohemiterpenoids
MW: 234.339
CB1 binding score: -16.107
InChIKey:VYWFYJIMNIWTLT-UHFFFAOYSA-N
ID: 52862
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N
ID: 52863
SMILES:c1(CCCCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.994
InChIKey:PPBWZNBXOLCSFA-UHFFFAOYSA-N
ID: 52864
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(CCC=C(C)C)(C)O1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.643
InChIKey:RVLFYROHYUUCLC-UHFFFAOYSA-N
ID: 52865
SMILES:C1C(C(O)=O)C2C(=C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.806
InChIKey:NGZNTWGUHRGDRK-UHFFFAOYSA-N
ID: 52866
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C=O)c-2c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -13.957
InChIKey:TVOIHBCIEPWHBL-UHFFFAOYSA-N
ID: 52867
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(c(C)cc(O)c3)=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -12.753
InChIKey:NBKQACOOQGDDDA-UHFFFAOYSA-N
ID: 52868
SMILES:CCOCc1oc(OC)c(C2CC(C)=CC(c3c(OC)ccc(CC[N+](C)(O)C)c3)C2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.657
CB1 binding score: -11.35
InChIKey:SVPPPBHPCOSONP-UHFFFAOYSA-N
ID: 52869
SMILES:C1C(C)(CCC=C(C)CO)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.614
InChIKey:YGKCDKHYUKYONC-UHFFFAOYSA-N
ID: 52870
SMILES:C1(OC(C)=O)C23C(=C)C(=O)OC2CC(C)C2(O3)C1c1c(O)cc(CCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.454
CB1 binding score: -12.143
InChIKey:RCSKDQFXNFTSQH-UHFFFAOYSA-N
ID: 52871
SMILES:C1C2(C)CC3c4c(O)cc(CCCCC)cc4OC13CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.317
InChIKey:RMFDFZRXPZLDIG-UHFFFAOYSA-N
ID: 52872
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C2(C)C1C(C)(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -11.442
InChIKey:NDCXOWVVRRACSP-UHFFFAOYSA-N
ID: 52873
SMILES:Oc1cc(O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 52874
SMILES:C(C1CC(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C1)(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.701
InChIKey:BTNDCPWCQTUIJS-UHFFFAOYSA-N
ID: 52875
SMILES:C(C)CCCc1cc(O)c2c(c1O)C1C(C(=C)C)CCC1(C)C(O)CC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.473
InChIKey:RCAXUZFEWGLWOA-UHFFFAOYSA-N
ID: 52876
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.706
InChIKey:LCQRHLUIMXHDPP-UHFFFAOYSA-N
ID: 52877
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(OC)cc(CC=C)c3)CCC1(C)C(=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -11.735
InChIKey:PJBRQVDIEZGFNV-UHFFFAOYSA-N
ID: 52878
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N