ID: 132742
SMILES:C(c1c(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c(O)c1C(=O)C(C)C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -12.55
InChIKey:PMFOTGYCUCSGIA-UHFFFAOYSA-N
ID: 132743
SMILES:C(=O)(C)OCC1=CCCC2(C)OC2c2c(c(C(OC)=O)cc(CCCC)c2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.243
InChIKey:JJVLWVMCPKMFMZ-UHFFFAOYSA-N
ID: 132744
SMILES:c1c(C(C)C)c(O)c(=O)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.929
InChIKey:AFUDOBPBEOLAKB-UHFFFAOYSA-N
ID: 132745
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.352
InChIKey:SCBXGWCGTJNXFA-UHFFFAOYSA-N
ID: 132746
SMILES:C(C=C)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -19.892
InChIKey:IHDZBQSJFRBIMW-UHFFFAOYSA-N
ID: 132747
SMILES:C(Cc1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(C2C=C(C)CCC2C(C)CCC=C(C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.772
CB1 binding score: -12.218
InChIKey:IZFHUPQLVBJVQB-UHFFFAOYSA-N
ID: 132748
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.935
InChIKey:MJXUOMRQWPNCBO-UHFFFAOYSA-N
ID: 132749
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 132750
SMILES:C12(C(C)C(O)C=C1C(C)C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.73
InChIKey:YQXGOQOKPONTAY-UHFFFAOYSA-N
ID: 132751
SMILES:c12c(cc(CCCCC)cc1O)OC1(C)CCC(C(C)C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.058
InChIKey:FWKBFUSGLZURMA-UHFFFAOYSA-N
ID: 132752
SMILES:C1(=O)CC(C(C)=C)C(c2c(CCCCC)cc(O)cc2O)C2C1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.73
InChIKey:YCBNUUNTUBBVFS-UHFFFAOYSA-N
ID: 132753
SMILES:Oc1cc(CC=C(C)CCC=C(C)C)c(O)cc1CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:BBIRKFDEXAZOPO-UHFFFAOYSA-N
ID: 132754
SMILES:C1(=C)C2C(CC(=C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.799
InChIKey:PQGHOZPGPJQVCJ-UHFFFAOYSA-N
ID: 132755
SMILES:CC1(C)Oc2c(ccc(C)c2)C2CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -16.137
InChIKey:NTKLHRSLOKITAR-UHFFFAOYSA-N
ID: 132756
SMILES:C(C=C(C)C)(CC(C)=CCc1c(O)cc(CO)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -16.502
InChIKey:FCXLGXOELQVHHD-UHFFFAOYSA-N
ID: 132757
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 132758
SMILES:O(CC(CO)O)C(CC=C(C)C)C(=CCc1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.59
CB1 binding score: -13.803
InChIKey:DZKZEKNMIJJJOB-UHFFFAOYSA-N
ID: 132759
SMILES:C1(=O)C(CC)(O)C(=O)C2=C1C1C(CCC(C)=C1)C(C)(C)Oc1c2ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -15.112
InChIKey:TULCFTJTLDYIMR-UHFFFAOYSA-N
ID: 132760
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 132761
SMILES:C1C(C)=CC(c2c(O)c(O)cc(C)c2)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.334
InChIKey:IYBXCHQIWCXGMJ-UHFFFAOYSA-N
ID: 132762
SMILES:O=C1CC(C)=CC2c3c(cc(CCCCC)cc3OC2(C)C)C1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -12.226
InChIKey:FFEWZVJRNIMCQZ-UHFFFAOYSA-N