ID: 104035
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 104036
SMILES:C1C(Oc2c(Oc3ccccc3)cc(C)c3c2C(C)(C)Oc2cc(CCCCC)cc(O)c23)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.69
CB1 binding score: -11.805
InChIKey:PKBBREFKHQBCSP-UHFFFAOYSA-N
ID: 104037
SMILES:c1(O)cc(CCCCC)cc2c1C1C=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: 104038
SMILES:C(CCc1cc(OC)c(O)c(C2C=C(C)CCC2C(=C)C)c1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.502
InChIKey:PSMXOISQSZCMNM-UHFFFAOYSA-N
ID: 104039
SMILES:C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 104040
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCCC=CCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -16.186
InChIKey:GDBTYGMOQKHWLJ-UHFFFAOYSA-N
ID: 104041
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 104042
SMILES:c1(CCC(O)=O)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -21.025
InChIKey:CUXNLZIJHQOPIO-UHFFFAOYSA-N
ID: 104043
SMILES:c1c(O)c2c(CC=C(C)C)cc(OC)cc2c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -16.209
InChIKey:XKJKWCVICKZIAX-UHFFFAOYSA-N
ID: 104044
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.776
InChIKey:RISKOFGQEFJODU-UHFFFAOYSA-N
ID: 104045
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(=C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 104046
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 104047
SMILES:c1(O)cc(CCCC)cc(O)c1C1(C)CCC2C(C)(C1)C(C)(C)CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -15.278
InChIKey:OSHMTZYUCAMCFM-UHFFFAOYSA-N
ID: 104048
SMILES:N1=C(c2c(O)c(C3C=C(C)CCC3C(C)=C)c(O)cc2)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 311.425
CB1 binding score: -15.633
InChIKey:AAMKHPLPWFYFLD-UHFFFAOYSA-N
ID: 104049
SMILES:C(=NCCc1ccccc1)(Oc1c(CCCCC)cc2c(c1)OC(C)(C)C1CCC(C)=CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 501.755
CB1 binding score: -13.817
InChIKey:IKSUXZSEXMDSKS-UHFFFAOYSA-N
ID: 104050
SMILES:O(C(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1C)C)C(=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.496
InChIKey:DXBKVBJNAXVSSH-UHFFFAOYSA-N
ID: 104051
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 104052
SMILES:C1C(C(=C)C)C(c2c(O)c(CCC)cc(O)c2O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.576
InChIKey:NGZGJWWHBNZHCS-UHFFFAOYSA-N
ID: 104053
SMILES:C1(C)(CO)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.583
InChIKey:AFSGVVWOXYAPKB-UHFFFAOYSA-N
ID: 104054
SMILES:COC(=O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.631
InChIKey:IPZKTTQQVCSCGI-UHFFFAOYSA-N
ID: 104055
SMILES:Oc1cc2c(cc1CCCCCC)OC1(C)C(C2(C)C)CCC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.959
InChIKey:UOOBNYIUWFUMQZ-UHFFFAOYSA-N