ID: 90889
SMILES:c1(C(=O)OC)cc(CCCCC)cc2c1OC(C)(C)C1CCC(=C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.961
InChIKey:PHFIITZIVSTXJI-UHFFFAOYSA-N
ID: 90890
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(COC(c3ccccc3)=O)CC1(O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.467
CB1 binding score: -15.279
InChIKey:YENLAZJDCGUVEB-UHFFFAOYSA-N
ID: 90891
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 90892
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C2=C(C)CCCC2(C)CCC1C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.314
InChIKey:BABSKTHCYUBGEV-UHFFFAOYSA-N
ID: 90893
SMILES:c1(C2=C(CC(C)C)C(=O)O2)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.435
InChIKey:VUUDOQAAGXPRHH-UHFFFAOYSA-N
ID: 90894
SMILES:C12=CC(C)=CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.957
InChIKey:BXBPYYDKENEJGP-UHFFFAOYSA-N
ID: 90895
SMILES:C1(C)(C)C2C(C)(CCC1OC(=O)C)Oc1ccc(CCCCC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: Not available
InChIKey:ZQSXHZWGGLOUIB-UHFFFAOYSA-N
ID: 90896
SMILES:c12c(cc(O)c(CCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.866
InChIKey:GRKLGEKOVABPPB-UHFFFAOYSA-N
ID: 90897
SMILES:C1(O)C(C)C2CC1C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.655
InChIKey:LLTRFWABMZETJM-UHFFFAOYSA-N
ID: 90898
SMILES:C(O)(C(C)C)C1OC2C(C(C=O)=C1)c1c(O)cc(CCCCC)cc1OC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.549
InChIKey:HEELXCXABUUYOA-UHFFFAOYSA-N
ID: 90899
SMILES:C(C(=CCCC(C)=CCc1c(O)c(C)cc(OC)c1)C)=COC(C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.038
InChIKey:OEDFQQUPAVKYNI-UHFFFAOYSA-N
ID: 90900
SMILES:C(C1(C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)CCC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -14.538
InChIKey:IXCOBEBYEWRHAH-UHFFFAOYSA-N
ID: 90901
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C(C=C(C)C)C1(C)C(=O)C(C(C(C)C)=O)=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.397
InChIKey:PKAVANYAVZMSDI-UHFFFAOYSA-N
ID: 90902
SMILES:C(=C)(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 90903
SMILES:C(CCC(C)=CCc1c(CC=C(C)C)c(O)cc(O)c1)=CC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.717
InChIKey:BFGOUJSKZPSTFX-UHFFFAOYSA-N
ID: 90904
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 90905
SMILES:c1(OC(C(=C)C)=O)c2c(cc(CCCCC)c1)OC1(C)C(C2)C(C(CCC=C(C)C)C)CCC1COC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.769
CB1 binding score: -15.034
InChIKey:ABVVRRHLHSTHQS-UHFFFAOYSA-N
ID: 90906
SMILES:COc1c(O)c2c(cc1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.049
InChIKey:ANBHAOJZFCATKM-UHFFFAOYSA-N
ID: 90907
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 90908
SMILES:CC1=CC(OC(C)=O)C2C1c1c(O)cc(CCCCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.502
InChIKey:ZCIHFUHILBNVPG-UHFFFAOYSA-N
ID: 90909
SMILES:C=C1C2OC3(CC1C)c1c(cc(CCCCC)cc1O)OC(C)(C)C3C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.599
InChIKey:QFVKDHQCHJGDKQ-UHFFFAOYSA-N