ID: 106870
SMILES:Oc1c(C(CC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 106871
SMILES:C1C(C)=CC(c2c(O)cc(CCC)oc2=O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.965
InChIKey:XDPFNSCPELVIIV-UHFFFAOYSA-N
ID: 106872
SMILES:C123c4c(O)cc(CCCCC)cc4OC(C(=C)C)(CC(C1)C(C)(O)CC2)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.083
InChIKey:OPILARRLPYNWSC-UHFFFAOYSA-N
ID: 106873
SMILES:C12C(c3c(cc(CCCCC)cc3O)O1)C(C(C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.059
InChIKey:DFDPTHLLXVCMEU-UHFFFAOYSA-N
ID: 106874
SMILES:O1c2cc(CCCCC)ccc2C2=C(O)C1C(CC=C(C)C)CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -11.847
InChIKey:MMQSRMGHLMLOBP-UHFFFAOYSA-N
ID: 106875
SMILES:Oc1cc2c(cc1CCCCC)C1C(C(=C)C)CCC(C)(O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.395
InChIKey:KEOQDLSKCADTQM-UHFFFAOYSA-N
ID: 106876
SMILES:C12C(c3c(O)cc(C)cc3OC1(C)C)CCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -14.702
InChIKey:YPMWKBWLXCPBPP-UHFFFAOYSA-N
ID: 106877
SMILES:C(C)(C)C(CC)c1c(C(=O)O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -9.98
InChIKey:SQAXSDDPWKLAII-UHFFFAOYSA-N
ID: 106878
SMILES:c1cc(CC=C(CCC=C(C)C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 106879
SMILES:C1(C)(C)Oc2cc(C)cc(O)c2C(=O)CC(C)=CCc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -15.17
InChIKey:AXAXHAODQZFKCZ-UHFFFAOYSA-N
ID: 106880
SMILES:C12(C)OC1CC1C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.608
InChIKey:DIZIBWOZVJVYLY-UHFFFAOYSA-N
ID: 106881
SMILES:C12C(O)(C(=O)C=C(C)C1)C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -20.159
InChIKey:CDUCTCFKRQNRCG-UHFFFAOYSA-N
ID: 106882
SMILES:c1(O)c(O)c(C2(C)CC(=CC)CC=C2C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.535
InChIKey:KQFVIPKPKSSKOU-UHFFFAOYSA-N
ID: 106883
SMILES:C(C)(C(OC)=O)c1c2c(c(C)cc1Br)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 407.348
CB1 binding score: -17.334
InChIKey:MCPSRBSOCDRUCI-UHFFFAOYSA-N
ID: 106884
SMILES:C(CCC)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -15.929
InChIKey:XBGOOGBJHYKSCH-UHFFFAOYSA-N
ID: 106885
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 106886
SMILES:C(C(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1OC)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.943
InChIKey:QOVOSRUONCHPIN-UHFFFAOYSA-N
ID: 106887
SMILES:C1(C)(O)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 106888
SMILES:CC1=CCc2c(O)cc(CCCCC)cc2OC(C)(C)C=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.9
InChIKey:VILKUIBZKVTRCV-UHFFFAOYSA-N
ID: 106889
SMILES:NCCc1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -16.418
InChIKey:YABXEUVMOOUKHI-UHFFFAOYSA-N
ID: 106890
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N