ID: 59032
SMILES:C1CC(CCC=C(C)C)(C)Oc2cc(CCCCC)cc(OP(=O)(O)O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.464
CB1 binding score: -16.074
InChIKey:XKDMSWBYAROTHM-UHFFFAOYSA-N
ID: 59033
SMILES:C(C1(C)CCc2c(C)cc(O)cc2O1)Cc1cc2c(c(O)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -14.252
InChIKey:XDQKMWZDMMFSCP-UHFFFAOYSA-N
ID: 59034
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)C)CCC(C)=C2)c(OCC=C(CCC=C(C)C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -19.687
InChIKey:SBOBOKNAXKJNFU-UHFFFAOYSA-N
ID: 59035
SMILES:CCCCCc1cc2c(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: 59036
SMILES:C1(OCC)(C(C)C)CCCC(Cc2c(O)cc(CCCC)cc2)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.988
InChIKey:SNNIXDOLOCTKCZ-UHFFFAOYSA-N
ID: 59037
SMILES:C(CCC)CCc1c(C(O)=O)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.907
InChIKey:OHSGMAFBRXWDAO-UHFFFAOYSA-N
ID: 59038
SMILES:CC1=C2C(C)(CCC2)c2c(cc(CCCCC)cc2O)OC1C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.123
InChIKey:JSKPPNYOAOUQCP-UHFFFAOYSA-N
ID: 59039
SMILES:CC(C)CCCC(=CCc1cc(O)cc2c1OC(C)(C)C1C2CC(O)(C)C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.806
InChIKey:BNJWBGRZCZNJMP-UHFFFAOYSA-N
ID: 59040
SMILES:O(c1c(O)cc(CCC)cc1O)CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.527
InChIKey:NLNRMEBLDWYUJH-UHFFFAOYSA-N
ID: 59041
SMILES:C1(CCC=C(C)C)=Cc2c(cc(CCCCC)cc2O)OC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.929
InChIKey:OWEQMQVVBVSOOY-UHFFFAOYSA-N
ID: 59042
SMILES:O(C)c1cc(OC)c(C)c2c1C(c1c(O)c(C(O)=O)c(CCCCC)cc1O)OC(C1(C)CCC(=C(C)C)C1)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.707
CB1 binding score: -15.288
InChIKey:PGEBCTVUPPBHSA-UHFFFAOYSA-N
ID: 59043
SMILES:c1(O)ccc2c(c1)OC(C)(CCC=C(CCC1C(C)(C)O1)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.334
InChIKey:PTBHCSGAOODKPC-UHFFFAOYSA-N
ID: 59044
SMILES:C(CC(O)CC(=O)O)(CCCc1cc(C(C(C(C)O)O)C)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.692
CB1 binding score: -13.663
InChIKey:PAXUHNBGZBKVPY-UHFFFAOYSA-N
ID: 59045
SMILES:C1CC2C(C=C1CO)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.959
InChIKey:ZQYICDSKJWGPKT-UHFFFAOYSA-N
ID: 59046
SMILES:C1=CC(C(=O)C)=CC2c3c(O)cc(CCCCC)cc3OC(C1C=C(C)C)C=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -13.887
InChIKey:DUOYERIHCBCAKW-UHFFFAOYSA-N
ID: 59047
SMILES:C(CC)CCc1cc2c(c(O)c1)C1=C(CC(C(O)(C)C)O1)C(C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.539
InChIKey:VTXKZOSQDXGBLY-UHFFFAOYSA-N
ID: 59048
SMILES:c1(CCC)cc(O)c2c(c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.792
InChIKey:XQGMRYMWQOMODG-UHFFFAOYSA-N
ID: 59049
SMILES:C123c4c(O)cc(CCCCC)cc4OC(C)(C)C1CCC(C)(O2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.841
InChIKey:YEUNANPCDAMXES-UHFFFAOYSA-N
ID: 59050
SMILES:C1(O)C(COC(C)=O)OC(Oc2cc3c(c(CC=C(CCC=C(C)C)C)c2)OC(C)(C)C2C3C=C(COC(=O)C)C(OC(=O)C)C2)C(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 700.822
CB1 binding score: -14.856
InChIKey:OHHWJWBCUAXQJW-UHFFFAOYSA-N
ID: 59051
SMILES:c1c(O)ccc2c1OC1(C)CC2C(C)(CCC=C(C)C)Oc2cc(C)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.926
InChIKey:MJBSQYXSWWSNRL-UHFFFAOYSA-N
ID: 59052
SMILES:C1C(C)=CCCC(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -17.798
InChIKey:QPXZACFNPMHKHS-UHFFFAOYSA-N