ID: 34609
SMILES:c1(O)c(C(=O)O)c(CCCCC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.336
InChIKey:KMDGJLSRAYSUDM-UHFFFAOYSA-N
ID: 34610
SMILES:O(C(=O)C)c1c(C)cc2c(c1)C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.948
InChIKey:YAGKIJDTZFYWEV-UHFFFAOYSA-N
ID: 34611
SMILES:C(CCCC)c1cc2c(c(O)c1)C13CC(C(C)(C)O1)CCC(C)C3CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.495
InChIKey:CGCUGRXGZVENFW-UHFFFAOYSA-N
ID: 34612
SMILES:C=C(C1C2c3c(O)cc(CCCCCC)cc3OC(C2(C)C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15
InChIKey:VTAJZJUUSQUUQE-UHFFFAOYSA-N
ID: 34613
SMILES:O(C(CC(C)=CCCC(=CCc1c(O)c(C)cc(OC)c1)C)=O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13
InChIKey:GWWYYSXSYVSECO-UHFFFAOYSA-N
ID: 34614
SMILES:CC(Oc1c2c(cc(C(=O)OC)c1)OC(C)(C)C1CC=C(C)CC21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -15.633
InChIKey:AFPHUDGJEJJMMA-UHFFFAOYSA-N
ID: 34615
SMILES:CC1(CO)C2=C(c3c(cc(CCCCC)cc3O)O1)CC(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.927
InChIKey:PUSIFAGYYHJNJN-UHFFFAOYSA-N
ID: 34616
SMILES:C(CC)Cc1c(O)c2c(cc1)C=CC(CCC=C(CCC=C(C)C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.934
InChIKey:OTICKWDOOGZRLS-UHFFFAOYSA-N
ID: 34617
SMILES:C(CCCC)c1cc2c(c(O)c1)C1COC2C(C(O)(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.929
InChIKey:KEMXFUMMVZNLBP-UHFFFAOYSA-N
ID: 34618
SMILES:C(CCC)Cc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.613
InChIKey:LVSZUBRWCZWTOQ-UHFFFAOYSA-N
ID: 34619
SMILES:C1(C)=CC(c2ccc(C)cc2O)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 34620
SMILES:C(C(Oc1cc(CCCCC)cc2c1c1c(c(O)c2)CC2C(C)(O1)CCC1C(C)(C)OC3C1C2C3(C)C)=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.764
CB1 binding score: -15.841
InChIKey:XNQSCAJBGCQVFF-UHFFFAOYSA-N
ID: 34621
SMILES:C(C(C)O)=CCC1C(C)=CC(c2cc(O)ccc2)C(O)C1(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.113
InChIKey:RXSUSQZMWSWHOD-UHFFFAOYSA-N
ID: 34622
SMILES:C1(=C)C2[CH]C(c3c(O)cc(CCCCC)cc3O)C(C)=CC2C(C(C)=C)CC1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.6
CB1 binding score: -16.782
InChIKey:SSSJEMLNPXTSHZ-UHFFFAOYSA-N
ID: 34623
SMILES:Oc1c(CC=C(C)C)cc(O)cc1CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 34624
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 34625
SMILES:O(C(=O)C1C2c3c(cc(CCCCC)cc3OC1C)C(C(C)C)CC2=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.322
InChIKey:OCHFVJGKFBRAJJ-UHFFFAOYSA-N
ID: 34626
SMILES:CC(OC1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.944
InChIKey:HTPNXIVNXAMVFM-UHFFFAOYSA-N
ID: 34627
SMILES:O1C(=O)C(C)=C2CC=C(C)CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.046
InChIKey:ZCXWWQIJQGYMQK-UHFFFAOYSA-N
ID: 34628
SMILES:C1(c2c(O)cc(CCCCCO)cc2O)=C(C)CC2C(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.195
InChIKey:CVOWZYZIZZJXHT-UHFFFAOYSA-N
ID: 34629
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N