ID: 88075
SMILES:Oc1c(OC)c(C)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.605
InChIKey:VDMBWSOUBMFUFN-UHFFFAOYSA-N
ID: 88076
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1=CCC(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -13.768
InChIKey:HQQAOKIFXNTFDQ-UHFFFAOYSA-N
ID: 88077
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=O)OC)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.502
InChIKey:SZHQBBUREXLHOC-UHFFFAOYSA-N
ID: 88078
SMILES:C(C(C)=CCC=C(CCC=C(C)C)C)Cc1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.389
InChIKey:GTOHWPHNDCLHJY-UHFFFAOYSA-N
ID: 88079
SMILES:C(c1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C2(C)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.869
InChIKey:XLIHJMXXXWJIKN-UHFFFAOYSA-N
ID: 88080
SMILES:C1C(C)=CCC2C(C2(C)C)Cc2c(c(C(=O)O)c(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.729
InChIKey:HOVYZXADQMVFGB-UHFFFAOYSA-N
ID: 88081
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 88082
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCC)c3C)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: Not available
InChIKey:HCPYBKBRKBQPKO-UHFFFAOYSA-N
ID: 88083
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC1C(C(=C)C2)CCC1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.299
InChIKey:XHYOVODGCKUBLS-UHFFFAOYSA-N
ID: 88084
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C)ccc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 88085
SMILES:C=CCc1cc2c(c(O)c1)C1C(=O)C(C)(C)OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.602
InChIKey:JDHPEPOBYMCFGV-UHFFFAOYSA-N
ID: 88086
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 88087
SMILES:C(C1C(=O)c2c(cc(CCCCC)cc2O)OC1C)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.058
InChIKey:SVWWXPUHDAFXIW-UHFFFAOYSA-N
ID: 88088
SMILES:C(CCCC)Cc1c2c(c(O)c(C=O)c1O)C1C(CC2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.087
InChIKey:UNXIUWZRUVEKLM-UHFFFAOYSA-N
ID: 88089
SMILES:Oc1c2c(c(C(=O)C(CC)C)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.127
InChIKey:MMJLZOYFZFYJGU-UHFFFAOYSA-N
ID: 88090
SMILES:C=C1CCCC(C)(C)C2C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.217
InChIKey:PVHDTRPHAZJSBH-UHFFFAOYSA-N
ID: 88091
SMILES:C1(=O)C(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.775
InChIKey:ZWCPUWAHHXMIBX-UHFFFAOYSA-N
ID: 88092
SMILES:C(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.565
InChIKey:SMVADMKDKAVIJM-UHFFFAOYSA-N
ID: 88093
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 88094
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C=C(CO)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.959
InChIKey:ZQYICDSKJWGPKT-UHFFFAOYSA-N
ID: 88095
SMILES:C(C1(C)C2C(C)(CCC1C(=C)COC(C)=O)Cc1c(cc(CCCCC)cc1O)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.267
InChIKey:RPXGBPVWQUSSNE-UHFFFAOYSA-N